Basic information
- CAS
31959-88-3- Standard SMILES
CN(C)CCCn1c(=O)n(-c2ccccc2)c2cc(Cl)ccc21.Cl.O- InChIKey
KUSWMSGQGZMJGX-UHFFFAOYSA-N- Molecular formula
- C18H23Cl2N3O2
- Average molar mass
- 384.3 g/mol
- Monoisotopic mass
- 383.1167324
Names & identifiers
- Preferred name
- Clodazon Hydrochloride
- IUPAC
- 5-chloro-1-[3-(dimethylamino)propyl]-3-phenylbenzimidazol-2-one;hydrate;hydrochloride
- English name
- Clodazon hydrochloride
- Molecular formula
- C18H23Cl2N3O2
- Molecular weight
- 384.30012
Names & synonyms
Clodazon hydrochlorideClodazon HCl31959-88-3Clodazon hydrochloride [USAN]UNII-FSF9L5AH4GFSF9L5AH4GHUF 2446HUF-2446AW-14'2446AW 142446AW-142446Clodazon hydrochloride (USAN)
Show more names
DTXSID40185789A W-14'24462H-Benzimidazol-2-one,5-chloro-1-(3-(dimethylamino)propyl)-1,3-dihydro-3-phenyl-, monohydrochloride, monohydrate5-Chloro-1-(3-(dimethylamino)propyl)-3-phenyl-2-benzimidazolinone monohydrochloride monohydrate5-Chloro-1-[3-(dimethylamino)propyl]-3-phenyl-2-benzimidazolinone monohydrochloride monohydrateRefChem:127022DTXCID301082805-chloro-1-[3-(dimethylamino)propyl]-3-phenyl-2-benzimidazolone hydrate hydrochloride
Database identifiers
- CAS
31959-88-3- PubChem CID
- 167451
- DTXSID
DTXSID40185789- ChEMBL
CHEMBL3989575- UNII
- FSF9L5AH4G
Properties
Computed structural properties
- Topological polar surface area
- 27.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 411
Physicochemical properties
- FDA UNII
- 9 L5AH4G · FSF9L5AH4G
Chemistry & industry
Applications
UsesAntidepressant.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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